Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1369030

C=CC[C@@](C)(O)[C@H](C)N.O=C(O)C(F)(F)F

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 3/20 0.33
DPP7 Q9UHL4 2/20 0.33
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
BLM P54132 1/20 0.32
SLC6A3 Q01959 1/20 0.32
MEN1 O00255 1/20 0.32
CYP2D6 P10635 1/20 0.32
NFKB1 P19838 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
DPP4 P27487 1/20 0.31
HTT P42858 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Trifluoroacetic Acid SCHEMBL1371201 1.00 DPP8 (0.33) DPP8DPP7TSHRALDH1A1SLC6A2
SCHEMBL12146089 0.85
SCHEMBL12146084 0.85
Trifluoroacetic Acid SCHEMBL1370109 0.78 DPP8 (0.36) DPP8DPP7TSHRALDH1A1MEN1
SCHEMBL803930 0.74 TSHR (0.35) TSHRALDH1A1SLC6A2SLC6A4BLM
Trifluoroacetic Acid SCHEMBL14737598 0.72 ALDH1A1 (0.37) DPP8DPP7TSHRALDH1A1DPP4
Trifluoroacetic Acid SCHEMBL7601287 0.72 ALDH1A1 (0.37) DPP8DPP7TSHRALDH1A1DPP4
Trifluoroacetic Acid SCHEMBL1980571 0.72 SLC7A5 (0.42) DPP8DPP7TSHRALDH1A1DPP4
SCHEMBL11064383 0.72 TSHR (0.36) TSHRALDH1A1SLC6A2SLC6A4BLM
SCHEMBL1369031 0.70

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140155376-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2014-06-05 US disclosed
EP-2571880-A1 PYRROLO [2, 3 - B]PYRAZINE - 7 - CARBOXAMIDE DERIVATIVES AND THEIR USE AS JAK AND SYK INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2013-03-27 EP disclosed
WO-2011144585-A1 PYRROLO [2, 3 - B] PYRAZINE - 7 - CARBOXAMIDE DERIVATIVES AND THEIR USE AS JAK AND SYK INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-11-24 WO disclosed
US-20110288067-A1 Pyrrolopyrazine Kinase Inhibitors HENDRICKS ROBERT THAN (US) 2011-11-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110288067-A1 Pyrrolopyrazine Kinase Inhibitors SYK, ZAP70, JAK2 DPP8 3414/4885DPP7 2027/4885TSHR 1271/4885
US-20140155376-A1 PYRROLOPYRAZINE KINASE INHIBITORS SYK, ZAP70, JAK2 DPP8 3414/4885DPP7 2027/4885TSHR 1271/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.